ethyl 2-azanyl-4-[3,5-bis(bromanyl)-2-methoxy-phenyl]-5-oxidanylidene-4,6,7,8-tetrahydrochromene-3-carboxylate

Systemtic Name: ethyl 2-azanyl-4-[3,5-bis(bromanyl)-2-methoxy-phenyl]-5-oxidanylidene-4,6,7,8-tetrahydrochromene-3-carboxylate Openeye Name: ethyl 2-amino-4-(3,5-dibromo-2-methoxy-phenyl)-5-oxo-4,6,7,8-tetrahydrochromene-3-carboxylate CAS Name: 2-amino-4-(3,5-dibromo-2-methoxyphenyl)-5-oxo-4,6,7,8-tetrahydro-1-benzopyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-amino-4-(3,5-dibromo-2-methoxyphenyl)-5-oxo-4,6,7,8-tetrahydrochromene-3-carboxylate Traditional Name: 2-amino-4-(3,5-dibromo-2-methoxy-phenyl)-5-keto-4,6,7,8-tetrahydrochromene-3-carboxylic acid ethyl ester Formula: C19H19Br2NO5 MolecularWeight: 501.16586

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=C(C1C3=CC(=CC(=C3OC)Br)Br)C(=O)CCC2)N

Isomeric SMILES

CCOC(=O)C1=C(OC2=C(C1C3=CC(=CC(=C3OC)Br)Br)C(=O)CCC2)N

InChI

InChI=1S/C19H19Br2NO5/c1-3-26-19(24)16-14(10-7-9(20)8-11(21)17(10)25-2)15-12(23)5-4-6-13(15)27-18(16)22/h7-8,14H,3-6,22H2,1-2H3